Performance of Density Functionals for Calculating Barrier Heights of Chemical Reactions Relevant to Astrophysics-Reference-Cited by-同舟云学术

Performance of Density Functionals for Calculating Barrier Heights of Chemical Reactions Relevant to Astrophysics

Published:2004-08-19 Issue:37 Volume:108 Page:7621-7636
ISSN:1089-5639
Container-title:The Journal of Physical Chemistry A
language:en
Short-container-title:J. Phys. Chem. A

Author:

Andersson Stefan¹,Grüning Myrta¹

Affiliation:

1. Leiden Observatory, P.O. Box 9513, 2300 RA Leiden, The Netherlands, Theoretical Chemistry, Leiden Institute of Chemistry, Leiden University, P.O. Box 9502, 2300 RA Leiden, The Netherlands, and Section Theoretical Chemistry, Vrije Universiteit, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/jp040448c

Reference136 articles.

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2. Ehrenfreund, P.; Fraser, H. J. InSolid State Astrochemistry; Pirronello, V., Krelowski, J., Eds.; Kluwer: Dordrecht, 2003; p 317.

3. Modeling Gas‐Grain Chemistry with Quantum Chemical Cluster Calculations. I. Heterogeneous Hydrogenation of CO and H2CO on Icy Grain Mantles

4. Efficient Formation of Formaldehyde and Methanol by the Addition of Hydrogen Atoms to CO in H[TINF]2[/TINF]O-CO Ice at 10 K

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